[3-(trifluoromethyl)phenyl]methyl 2-[(4-methoxyphenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: [3-(trifluoromethyl)phenyl]methyl 2-[(4-methoxyphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: [3-(trifluoromethyl)phenyl]methyl 2-[(4-methoxybenzoyl)amino]-3-methyl-butanoate CAS Name: 2-[[(4-methoxyphenyl)-oxomethyl]amino]-3-methylbutanoic acid [3-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [3-(trifluoromethyl)phenyl]methyl 2-[(4-methoxybenzoyl)amino]-3-methylbutanoate Traditional Name: 3-methyl-2-(p-anisoylamino)butyric acid [3-(trifluoromethyl)benzyl] ester Formula: C21H22F3NO4 MolecularWeight: 409.39889

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC(=CC=C1)C(F)(F)F)NC(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)C(C(=O)OCC1=CC(=CC=C1)C(F)(F)F)NC(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C21H22F3NO4/c1-13(2)18(25-19(26)15-7-9-17(28-3)10-8-15)20(27)29-12-14-5-4-6-16(11-14)21(22,23)24/h4-11,13,18H,12H2,1-3H3,(H,25,26)